O2-methyl O1-(phenylmethyl) (2S,7aR)-6-oxidanylidene-7,7a-dihydro-2H-indole-1,2-dicarboxylate

Systemtic Name: O2-methyl O1-(phenylmethyl) (2S,7aR)-6-oxidanylidene-7,7a-dihydro-2H-indole-1,2-dicarboxylate Openeye Name: O1-benzyl O2-methyl (2S,7aR)-6-oxo-7,7a-dihydro-2H-indole-1,2-dicarboxylate CAS Name: (2S,7aR)-6-oxo-7,7a-dihydro-2H-indole-1,2-dicarboxylic acid O2-methyl ester O1-(phenylmethyl) ester IUPAC Name: 1-O-benzyl 2-O-methyl (2S,7aR)-6-oxo-7,7a-dihydro-2H-indole-1,2-dicarboxylate Traditional Name: (2S,7aR)-6-keto-7,7a-dihydro-2H-indole-1,2-dicarboxylic acid O1-benzyl ester O2-methyl ester Formula: C18H17NO5 MolecularWeight: 327.33128

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C=C2C=CC(=O)CC2N1C(=O)OCC3=CC=CC=C3

Isomeric SMILES

COC(=O)[C@@H]1C=C2C=CC(=O)C[C@H]2N1C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C18H17NO5/c1-23-17(21)16-9-13-7-8-14(20)10-15(13)19(16)18(22)24-11-12-5-3-2-4-6-12/h2-9,15-16H,10-11H2,1H3/t15-,16+/m1/s1